Transition-metal-catalyzed C–H bond activation for the formation of C–C bonds in complex molecules

JH Docherty, TM Lister, G Mcarthur, MT Findlay… - Chemical …, 2023 - ACS Publications
Site-predictable and chemoselective C–H bond functionalization reactions offer synthetically
powerful strategies for the step-economic diversification of both feedstock and fine …

Information entropy in chemistry: An overview

DS Sabirov, IS Shepelevich - Entropy, 2021 - mdpi.com
Basic applications of the information entropy concept to chemical objects are reviewed.
These applications deal with quantifying chemical and electronic structures of molecules …

Chemical evolution of natural product structure

M Grigalunas, S Brakmann… - Journal of the American …, 2022 - ACS Publications
Natural products are the result of Nature's exploration of biologically relevant chemical
space through evolution and an invaluable source of bioactive small molecules for chemical …

Identifying molecules as biosignatures with assembly theory and mass spectrometry

SM Marshall, C Mathis, E Carrick, G Keenan… - Nature …, 2021 - nature.com
The search for alien life is hard because we do not know what signatures are unique to life.
We show why complex molecules found in high abundance are universal biosignatures and …

SCScore: synthetic complexity learned from a reaction corpus

CW Coley, L Rogers, WH Green… - Journal of chemical …, 2018 - ACS Publications
Several definitions of molecular complexity exist to facilitate prioritization of lead
compounds, to identify diversity-inducing and complexifying reactions, and to guide …

Structural simplification of natural products

S Wang, G Dong, C Sheng - Chemical Reviews, 2019 - ACS Publications
Natural products (NPs) are important sources of clinical drugs due to their structural diversity
and biological prevalidation. However, the structural complexity of NPs leads to synthetic …

Pseudo natural products—chemical evolution of natural product structure

G Karageorgis, DJ Foley, L Laraia… - Angewandte Chemie …, 2021 - Wiley Online Library
Pseudo‐natural products (PNPs) combine natural product (NP) fragments in novel
arrangements not accessible by current biosynthesis pathways. As such they can be …

Choose and use your chemical probe wisely to explore cancer biology

J Blagg, P Workman - Cancer cell, 2017 - cell.com
Small-molecule chemical probes or tools have become progressively more important in
recent years as valuable reagents to investigate fundamental biological mechanisms and …

Organocatalytic Enantioselective Construction of Chiral Azepine Skeleton Bearing Multiple‐Stereogenic Elements

S Huang, H Wen, Y Tian, P Wang, W Qin… - Angewandte …, 2021 - Wiley Online Library
Enantioselective construction of molecules bearing multiple stereogenic elements is
increasingly related to the synthesis of enantiopure natural products, pharmaceuticals, and …

Cradle-to-gate greenhouse gas emissions for twenty anesthetic active pharmaceutical ingredients based on process scale-up and process design calculations

AG Parvatker, H Tunceroglu, JD Sherman… - ACS Sustainable …, 2019 - ACS Publications
Comparative life-cycle assessment (LCA) of pharmaceutical drugs would enable clinicians
to choose alternatives with lower environmental impact from options offering equivalent …